SCHEMBL11279991

SCHEMBL11279991

CCCCC1NC(=O)COC12CCN(c1ccccc1CC)CC2

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 1/20 0.37
MEN1 O00255 1/20 0.36
LMNA P02545 1/20 0.36
MAPT P10636 1/20 0.36
KMT2A Q03164 1/20 0.36
ALOX5 P09917 1/20 0.35
DRD2 P14416 4/20 0.35
DRD3 P35462 4/20 0.35
DRD4 P21917 3/20 0.35
HTR1A P08908 2/20 0.35
HTR2A P28223 2/20 0.35
HTR2C P28335 2/20 0.35
PRKCD Q05655 4/20 0.34
TSHR P16473 1/20 0.33
GRM2 Q14416 1/20 0.33
CASP1 P29466 1/20 0.33
CASP7 P55210 1/20 0.33
HTR7 P34969 2/20 0.32
TACR3 P29371 1/20 0.32
ADRB2 P07550 1/20 0.32

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL11290953 0.89 TRPV1 (0.39) TRPV1MEN1LMNAMAPTKMT2A
SCHEMBL11288979 0.83 LMNA (0.42) TRPV1MEN1LMNAMAPTKMT2A
SCHEMBL11284731 0.80 TRPV1 (0.38) TRPV1MEN1LMNAMAPTKMT2A
SCHEMBL11233235 0.76 DRD2 (0.41) MEN1LMNAKMT2ADRD2DRD3
SCHEMBL11281332 0.75 TSHR (0.35) TRPV1MEN1LMNAMAPTKMT2A
SCHEMBL11281691 0.75 DRD2 (0.39) MEN1LMNAKMT2ADRD2DRD3
SCHEMBL11281527 0.75 HTR2A (0.47) DRD2DRD3DRD4HTR1AHTR2A
SCHEMBL11235867 0.73 ALDH1A1 (0.36) MEN1LMNAMAPTKMT2ADRD2
SCHEMBL11289006 0.71 LMNA (0.39) TRPV1MEN1LMNAMAPTKMT2A
SCHEMBL11285195 0.71 LMNA (0.41) TRPV1MEN1LMNAMAPTKMT2A

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4353900-A HYPOTENSIVE, ANTIARRHYTHMIA, CARDIOTONIC, VASODILATORS SYNTEX (U.S.A.) INC. (US) 1982-10-12 US disclosed